SCHEMBL3204906

SCHEMBL3204906

CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCC(CC)C(=O)OC[C@H](COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)C(CC)CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CC

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.53
SMN1; SMN2 Q16637 3/20 0.48
NR5A2 O00482 1/20 0.48
NR5A1 Q13285 1/20 0.48
MAPT P10636 1/20 0.47
ADRA1D P25100 1/20 0.46
PTAFR P25105 1/20 0.46
HTR1D P28221 1/20 0.46
HTR2C P28335 1/20 0.46
ADRA1B P35368 1/20 0.46
DRD3 P35462 1/20 0.46
TMEM97 Q5BJF2 1/20 0.46
RECQL P46063 1/20 0.42
PRKD3 O94806 1/20 0.40
PRKCG P05129 1/20 0.40
PRKCB P05771 1/20 0.40
PRKCA P17252 1/20 0.40
PRKCH P24723 1/20 0.40
AKT1 P31749 1/20 0.40
PRKCI P41743 1/20 0.40

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL13491205 0.90 FABP3 (0.48) ALDH1A1SMN1; SMN2NR5A2NR5A1MAPT
SCHEMBL29482557 0.82 SMN1; SMN2 (0.67) ALDH1A1SMN1; SMN2NR5A2NR5A1MAPT
SCHEMBL2125477 0.82 SMN1; SMN2 (0.67) ALDH1A1SMN1; SMN2NR5A2NR5A1MAPT
SCHEMBL3208533 0.81 ADORA3 (0.40) ALDH1A1MAPTRECQLMEN1LMNA
SCHEMBL30884201 0.80 ALDH1A1 (0.74) ALDH1A1SMN1; SMN2NR5A2NR5A1MAPT
SCHEMBL29870836 0.80 ALDH1A1 (0.74) ALDH1A1SMN1; SMN2NR5A2NR5A1MAPT
SCHEMBL14780582 0.79 SELP (0.43) NR5A2NR5A1
SCHEMBL30536890 0.79 ALDH1A1 (0.73) ALDH1A1SMN1; SMN2NR5A2NR5A1MAPT
SCHEMBL235516 0.79 ALDH1A1 (0.74) ALDH1A1SMN1; SMN2NR5A2NR5A1MAPT
SCHEMBL29934680 0.79 ALDH1A1 (0.74) ALDH1A1SMN1; SMN2NR5A2NR5A1MAPT

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8399516-B2 Alpha-substituted omega-3 lipids that are activators or modulators of the peroxisome proliferators-activated receptor (PPAR) PRONOVA BIOPHARMA NORGE AS (NO) 2013-03-19 US claimed
US-20100035990-A1 ALPHA-SUBSTITUTED OMEGA-3 LIPIDS THAT ARE ACTIVATORS OR MODULATORS OF THE PEROXISOME PROLIFERATORS-ACTIVATED RECEPTOR (PPAR) PRONOVA BIOPHARMA NORGE AS (NO) 2010-02-11 US claimed
US-8399516-B2 Alpha-substituted omega-3 lipids that are activators or modulators of the peroxisome proliferators-activated receptor (PPAR) PRONOVA BIOPHARMA NORGE AS (NO) 2013-03-19 US disclosed
US-20100035990-A1 ALPHA-SUBSTITUTED OMEGA-3 LIPIDS THAT ARE ACTIVATORS OR MODULATORS OF THE PEROXISOME PROLIFERATORS-ACTIVATED RECEPTOR (PPAR) PRONOVA BIOPHARMA NORGE AS (NO) 2010-02-11 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100035990-A1 ALPHA-SUBSTITUTED OMEGA-3 LIPIDS THAT ARE ACTIVATORS OR MODULATORS OF THE PEROXISOME PROLIFERATORS-ACTIVATED RECEPTOR (PPAR) PPARG, PPARA, FFAR3 ALDH1A1 1088/4885SMN1; SMN2 3867/4885NR5A2 821/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.